EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:196674 - PE(18:1(9Z)/15:1(9Z))

ChEBI IDCHEBI:196674
ChEBI NamePE(18:1(9Z)/15:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H72NO8P
Net Charge0
Average Mass701.967
Monoisotopic Mass701.49955
SMILESCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C38H72NO8P/c1-3-5-7-9-11-13-15-17-18-19-21-22-24-26-28-30-37(40)44-34-36(35-46-48(42,43)45-33-32-39)47-38(41)31-29-27-25-23-20-16-14-12-10-8-6-4-2/h12,14,17-18,36H,3-11,13,15-16,19-35,39H2,1-2H3,(H,42,43)/b14-12-,18-17-/t36-/m1/s1
InChIKeyHZPQFFIXCQBTGI-GDVOPVSPSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(18:1(9Z)/15:1(9Z)) (CHEBI:196674) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-pentadec-9-enoyl]oxypropyl] (Z)-octadec-9-enoate
Manual XrefsDatabases
113375608ChemSpider
LMGP02010639LIPID MAPS